Vitas-M small molecule compound
(5Z)-2-(azepan-1-yl)-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazol-4(5H)-one
Catalog ID
STK795158
SMILES COc1cc(/C=C/2\SC(=NC2=O)N2CCCCCC2)cc(c1OC)OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H24N2O4S MW 376.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N2O4S/c1-23-14-10-13(11-15(24-2)17(14)25-3)12-16-18(22)20-19(26-16)21-8-6-4-5-7-9-21/h10-12H,4-9H2,1-3H3/b16-12-InChIKey
OHVAIHPVLHIYLX-VBKFSLOCSA-NSynonyms
5955-00-0(5Z)2(AZEPAN1YL)5((345TRIMETHOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)2(azepan1yl)5(345trimethoxybenzylidene)13thiazol4(5H)one
(E)2(azepan1yl)5(345trimethoxybenzylidene)thiazol4(5H)one
5955000
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)N=C(S2)N3CCCCCC3
COc1cc(C=C2SC(=NC2=O)N2CCCCCC2)cc(c1OC)OC
InChI=1SC19H24N2O4Sc123141013(1115(242)17(14)253)121618(22)2019(2616)2186457921h1012H49H213H3b1612
MFCD01208711
ZINC000013547680
ZINC13547680
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